ID: 39355
SMILES:C1(=O)C(C)CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.046
InChIKey:UECUNLJHUBNWSC-UHFFFAOYSA-N
ID: 39356
SMILES:O=C(CC(C)C)c1c(O)c2c(cc1C(O)=O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -14.445
InChIKey:IQSKDEXEOMYTCJ-UHFFFAOYSA-N
ID: 39357
SMILES:c1(O)c(C2(C)C(C(C)=C)CCC2(O)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -13.385
InChIKey:FLYDNFPQQYOEGF-UHFFFAOYSA-N
ID: 39358
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.841
InChIKey:UKPNRAMYBFBWKV-UHFFFAOYSA-N
ID: 39359
SMILES:C1C(=O)C2(C)C(C3(Oc4cc(CCCCC)cc(O)c43)O2)C2(C)CC3CC(C)(C)CC3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -16.363
InChIKey:BNGJQLSJMHOTIB-UHFFFAOYSA-N
ID: 39360
SMILES:CC(CC(O)CC(C)=CCc1c(O)cc(CCCCC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.619
CB1 binding score: -16.054
InChIKey:UVODIGUMPABKGP-UHFFFAOYSA-N
ID: 39361
SMILES:Oc1c(=O)c2c(cc(O)c1O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.342
CB1 binding score: -14.605
InChIKey:QZZHQOGWFRCPDE-UHFFFAOYSA-N
ID: 39362
SMILES:c1c(O)cc(CCC)c2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.632
InChIKey:GZTFZZGSTIIBAC-UHFFFAOYSA-N
ID: 39363
SMILES:O1C2(C)CC1(O)Oc1c2c(OC(C(CC)C)=O)cc2c1OC(C)(C)C1C2C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.498
CB1 binding score: -13.29
InChIKey:POJGGXWGIZCWJR-UHFFFAOYSA-N
ID: 39364
SMILES:c1(CCCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 39365
SMILES:C1C2(C(C)C)Oc3c(c(O)cc(CCCC)c3O2)C2CC(C)CCC12O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.777
InChIKey:WEDJZEGKNUAROB-UHFFFAOYSA-N
ID: 39366
SMILES:CC(CCC=C(C)C)=CCc1c(O)cc(CCCCCO)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.775
InChIKey:BPLYFGRGSWNQPD-UHFFFAOYSA-N
ID: 39367
SMILES:CC1=CC2=C(C(C)(C)Oc3c2cc(CCCCC)cc3O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.591
InChIKey:FBIPJSIZKVZXQC-UHFFFAOYSA-N
ID: 39368
SMILES:C1C(=O)c2c(cc(CCCCC)cc2O)OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -18.915
InChIKey:QGXPGVCOVFFYDF-UHFFFAOYSA-N
ID: 39369
SMILES:c1(O)cc(CCCCC)cc(O)c1C(=O)C1(C)CC(C(C)=C)C(C)(C)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -17.041
InChIKey:HPIWZVQFVRXJSO-UHFFFAOYSA-N
ID: 39370
SMILES:C(C1CCC(C)=CC1c1c(O)cc(CCCCCO)cc1OC)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -14.936
InChIKey:KNSFWRBHMFSXEN-UHFFFAOYSA-N
ID: 39371
SMILES:c12c(OC)c3c(O)c(C)c(CC(OCCC)C1C)OC(C)(C)C1C3C2C(=O)C(C)(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -13.06
InChIKey:IFWCQOMCPMKQPT-UHFFFAOYSA-N
ID: 39372
SMILES:C1(C(C)C)CCC(C)C2(Br)C1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 395.381
CB1 binding score: -14.188
InChIKey:ZXWJHIARLXXFMK-UHFFFAOYSA-N
ID: 39373
SMILES:C(CCc1cc2c(c(O)c1)C1C(CC(C)C)(O2)C(C)(O)CCC1C(C)(O)C)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.629
CB1 binding score: -11.961
InChIKey:MTCBTRATOYJDOS-UHFFFAOYSA-N
ID: 39374
SMILES:c12c(c(C3C(C(C)C)CCC(C)=C3)c(C)cc1)OC(C)(CCC=C(CO)C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -16.846
InChIKey:MXUMZKJDPVCAJU-UHFFFAOYSA-N
ID: 39375
SMILES:C1C(O)(C)COc2c(c(O)cc(CCCCC)c2)C1C1(CO)OC(C)(C)OC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.508
CB1 binding score: -13.687
InChIKey:RSGRANLNFXYNTK-UHFFFAOYSA-N